In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 21 | Yes |
Popular Name: N'-[(3R)-1-benzyl-3-piperidyl]-N,N-diethyl-ethane-1,2-diamine N'-[(3R)-1-benzyl-3-piperidyl]-N…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.70 | 9.51 | -85.56 | 3 | 3 | 2 | 21 | 291.483 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.70 | 7.36 | -35.4 | 2 | 3 | 1 | 20 | 290.475 | 8 | ↓ |